SCHEMBL4201841

SCHEMBL4201841

O=C(O)c1cc2cc(Cl)ccc2n1Cc1ccc(C(F)(F)F)cc1

nearest known ligand 0.77

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 16/20 0.77
ABCB11 O95342 2/20 0.64
CCR9 P51686 3/20 0.63

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3198946 0.89 CCR2 (0.71) CCR2ABCB11CCR9
SCHEMBL4217582 0.88 CCR2 (0.70) CCR2ABCB11CCR9
SCHEMBL6302546 0.87 CCR2 (1.00) CCR2ABCB11
SCHEMBL4206942 0.86 CCR2 (0.68) CCR2ABCB11CCR9
SCHEMBL13802525 0.86 CCR2 (0.71) CCR2ABCB11CCR9
SCHEMBL4537700 0.86 CCR2 (0.76) CCR2ABCB11
SCHEMBL3205608 0.85 CCR2 (0.63) CCR2ABCB11CCR9
SCHEMBL3209668 0.85 CCR2 (0.74) CCR2ABCB11
SCHEMBL4208025 0.85 CCR2 (0.74) CCR2ABCB11CCR9
SCHEMBL27658570 0.84 CCR2 (0.82) CCR2ABCB11CCR9

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009063495-A2 SUBSTITUTED INDOLE AND ITS DERIVATIVES AS CANNABINOID MODULATORS CADILA HEALTHCARE LIMITED (IN) 2009-05-22 WO claimed
US-20090155903-A1 PHARMACEUTICAL COMPOSITION AND METHOD MYRIAD GENETICS, INCORPORATED (US) 2009-06-18 US disclosed
US-20090155903-A1 PHARMACEUTICAL COMPOSITION AND METHOD MYRIAD GENETICS, INCORPORATED (US) 2009-06-18 US disclosed
US-20090155903-A1 PHARMACEUTICAL COMPOSITION AND METHOD MYRIAD GENETICS, INCORPORATED (US) 2009-06-18 US disclosed
WO-2009063495-A2 SUBSTITUTED INDOLE AND ITS DERIVATIVES AS CANNABINOID MODULATORS CADILA HEALTHCARE LIMITED (IN) 2009-05-22 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090155903-A1 PHARMACEUTICAL COMPOSITION AND METHOD APP, PSEN2, PSEN1 CCR2 1386/4885ABCB11 529/4885CCR9 2109/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.